tert-butyl 3-[[cyclopropyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-4-nitro-benzoate

Systemtic Name: tert-butyl 3-[[cyclopropyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-4-nitro-benzoate Openeye Name: tert-butyl 3-[[tert-butoxycarbonyl(cyclopropyl)amino]methyl]-4-nitro-benzoate CAS Name: 3-[[cyclopropyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-4-nitrobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[cyclopropyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-4-nitrobenzoate Traditional Name: 3-[[tert-butoxycarbonyl(cyclopropyl)amino]methyl]-4-nitro-benzoic acid tert-butyl ester Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])CN(C2CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])CN(C2CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H28N2O6/c1-19(2,3)27-17(23)13-7-10-16(22(25)26)14(11-13)12-21(15-8-9-15)18(24)28-20(4,5)6/h7,10-11,15H,8-9,12H2,1-6H3